CID 67418341

2-(2,3-dihydro-1h-inden-1-yl)ethane-1-sulfonamide

Structural Information

Molecular Formula

C₁₁H₁₅NO₂S

SMILES

C1CC2=CC=CC=C2C1CCS(=O)(=O)N

InChI

InChI=1S/C11H15NO2S/c12-15(13,14)8-7-10-6-5-9-3-1-2-4-11(9)10/h1-4,10H,5-8H2,(H2,12,13,14)

InChIKey

ZSFJCCBRANSLIL-UHFFFAOYSA-N

Compound name

2-(2,3-dihydro-1H-inden-1-yl)ethanesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 225.08235 Da
Monoisotopic Mass: 1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	226.089626	148.8
[M+Na]+	248.071568	156.9
[M-H]-	224.075074	152.9
[M+NH4]+	243.116173	170.1
[M+K]+	264.045508	153.2
[M+H-H2O]+	208.079610	143.8
[M+HCOO]-	270.080551	166.4
[M+CH3COO]-	284.096201	187.0
[M+Na-2H]-	246.057016	152.4
[M]+	225.08180142	149.7
[M]-	225.08289858	149.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe